4H-Cyclohepta(def)phenanthrene
TL;DR: 4H-Cyclohepta(def)phenanthrene (CAS 19561-31-0) is a chemical compound with molecular formula C17H12 and molecular weight 216.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetracyclo[7.6.2.05,17.012,16]heptadeca-1,3,5,7,9,12,14,16-octaene
Also Known As: 4H-CYCLOHEPTA(DEF)PHENANTHRENE, 4H-Cyclohepta[def]phenanthrene, 5H-Cyclohepta[def]phenanthrene, J1.608.467K, tetracyclo[7.6.2.05,17.012,16]heptadeca-1,3,5,7,9,12,14,16-octaene
| Molecular Formula | C17H12 |
|---|---|
| Molecular Weight | 216.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.0939 |
| Heavy Atoms | 17 |
| Complexity | 650.0 |
Chemical Identifiers
| CAS Number | 19561-31-0 |
|---|---|
| SMILES | C1C=C2C=CC=C3C2=C4C1=CC=CC4=CC=C3 |
| InChIKey | MZJKHQKKQFRCFR-UHFFFAOYSA-N |
Product Overview
4H-Cyclohepta(def)phenanthrene (CAS 19561-31-0), with molecular formula C17H12 and molecular weight 216.09 g/mol. IUPAC: tetracyclo[7.6.2.05,17.012,16]heptadeca-1,3,5,7,9,12,14,16-octaene.
Chemical Property Profile of 4H-Cyclohepta(def)phenanthrene
Property Insights of 4H-Cyclohepta(def)phenanthrene
The XLogP value of 3.0 indicates that 4H-Cyclohepta(def)phenanthrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4H-Cyclohepta(def)phenanthrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Cyclohepta(def)phenanthrene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4H-Cyclohepta(def)phenanthrene?
The CAS number of 4H-Cyclohepta(def)phenanthrene is 19561-31-0.
What is the molecular formula of 4H-Cyclohepta(def)phenanthrene?
The molecular formula of 4H-Cyclohepta(def)phenanthrene is C17H12.
What is the molecular weight of 4H-Cyclohepta(def)phenanthrene?
The molecular weight of 4H-Cyclohepta(def)phenanthrene is 216.09 g/mol.
Where can I buy 4H-Cyclohepta(def)phenanthrene?
You can request a quote for 4H-Cyclohepta(def)phenanthrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Cyclohepta(def)phenanthrene?
Yes, KEHONG BIO provides custom synthesis services for 4H-Cyclohepta(def)phenanthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.